Home Other Building Blocks 5-Oxo-5-(thiophen-2-yl)pentanoic acid

5-Oxo-5-(thiophen-2-yl)pentanoic acid

CAS No.:
22971-62-6
Catalog Number:
AG002LQL
Molecular Formula:
C9H10O3S
Molecular Weight:
198.2389
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$111
- +
5g
95%
In Stock USA
United States
$154
- +
Product Description
Catalog Number:
AG002LQL
Chemical Name:
5-Oxo-5-(thiophen-2-yl)pentanoic acid
CAS Number:
22971-62-6
Molecular Formula:
C9H10O3S
Molecular Weight:
198.2389
MDL Number:
MFCD00151848
IUPAC Name:
5-oxo-5-thiophen-2-ylpentanoic acid
InChI:
InChI=1S/C9H10O3S/c10-7(3-1-5-9(11)12)8-4-2-6-13-8/h2,4,6H,1,3,5H2,(H,11,12)
InChI Key:
GSQMRVFOHNXKOR-UHFFFAOYSA-N
SMILES:
OC(=O)CCCC(=O)c1cccs1
NSC Number:
80412
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.035g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.236g/mol
Monoisotopic Mass:
198.035g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
82.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties